3-pyrazin-2-yl-1,2,4-triazine

C7H5N5 — CID 67443903

IUPAC3-pyrazin-2-yl-1,2,4-triazine
SMILESc1cnc(-c2nccnn2)cn1
InChIInChI=1S/C7H5N5/c1-2-9-6(5-8-1)7-10-3-4-11-12-7/h1-5H
InChIKeyPJSLBLWZGPMPCK-UHFFFAOYSA-N
MW159.15 g/mol
LogP0.33
Rot. Bonds1

About 3-pyrazin-2-yl-1,2,4-triazine

3-pyrazin-2-yl-1,2,4-triazine (PubChem CID 67443903) has the molecular formula C7H5N5 and a molecular weight of 159.15 g/mol. Its IUPAC name is 3-pyrazin-2-yl-1,2,4-triazine.

Molecular Properties

Compound Name3-pyrazin-2-yl-1,2,4-triazine
PubChem CID67443903
Molecular FormulaC7H5N5
Molecular Weight159.15 g/mol
Exact Mass159.05
IUPAC Name3-pyrazin-2-yl-1,2,4-triazine
SMILESc1cnc(-c2nccnn2)cn1
InChIInChI=1S/C7H5N5/c1-2-9-6(5-8-1)7-10-3-4-11-12-7/h1-5H
InChIKeyPJSLBLWZGPMPCK-UHFFFAOYSA-N
XLogP0.33
TPSA64.45 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.15
LogP ≤ 50.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

tris(2-pyrazin-2-ylpyrazine);ruthenium(1+)
CID 138986841
5-pyrazin-2-yltetrazine
CID 66671872
2-(5-pyridazin-3-yl-4-pyrimidin-2-yl-3-pyridinyl)pyrazine
CID 91297006
3-(1,2,4-triazin-3-yl)-1,2,4,5-tetrazine
CID 90851079
4-pyrazin-2-yltriazine
CID 69484540
3-pyrazin-2-yl-1,2,4-thiadiazole
CID 57234725
3-phenyl-1,2,4-triazine
CID 71236553
2-pyrazin-2-yl-4-pyridin-2-ylpyrimidine
CID 141116052
2-deuterio-3-pyrazin-2-ylpyrazine
CID 176902269
2-(4-methyl-1,2,4-triazol-3-yl)pyrazine
CID 15455218
2-(3,4,5-trimethylphenyl)pyrazine
CID 126550614
2-(2,6-dimethylphenyl)pyrazine
CID 91666747

Frequently Asked Questions

What is the IUPAC name of 3-pyrazin-2-yl-1,2,4-triazine?
The IUPAC name of 3-pyrazin-2-yl-1,2,4-triazine (CID 67443903) is 3-pyrazin-2-yl-1,2,4-triazine.
What is the SMILES notation for 3-pyrazin-2-yl-1,2,4-triazine?
The canonical SMILES for 3-pyrazin-2-yl-1,2,4-triazine is c1cnc(-c2nccnn2)cn1.
What is the InChIKey of 3-pyrazin-2-yl-1,2,4-triazine?
The InChIKey is PJSLBLWZGPMPCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5N5/c1-2-9-6(5-8-1)7-10-3-4-11-12-7/h1-5H.
What are the key properties of 3-pyrazin-2-yl-1,2,4-triazine?
3-pyrazin-2-yl-1,2,4-triazine has a molecular weight of 159.15 g/mol, XLogP of 0.33, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-pyrazin-2-yl-1,2,4-triazine is sourced from PubChem (CID 67443903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).